5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[2-(4-chlorophenyl)sulfonylethylthio]-N-ethyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[2-(4-chlorophenyl)sulfonylethylsulfanyl]-N-ethyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[2-(4-chlorophenyl)sulfonylethylthio]-1,3,4-thiadiazol-2-yl]-ethyl-amine Formula: C12H14ClN3O2S3 MolecularWeight: 363.90646

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCCS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCNC1=NN=C(S1)SCCS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C12H14ClN3O2S3/c1-2-14-11-15-16-12(20-11)19-7-8-21(17,18)10-5-3-9(13)4-6-10/h3-6H,2,7-8H2,1H3,(H,14,15)